LAMMPS (27 Nov 2018)
  using 1 OpenMP thread(s) per MPI task
# 2d NEMD simulation

units		lj
atom_style	atomic
dimension	2

lattice		sq2 0.8442
Lattice spacing in x,y,z = 1.53919 1.53919 1.53919
region		box prism 0 10 0 8 -0.5 0.5 0 0 0
create_box	2 box
Created triclinic box = (0 0 -0.769595) to (15.3919 12.3135 0.769595) with tilt (0 0 0)
  2 by 2 by 1 MPI processor grid
create_atoms	1 box
Created 160 atoms
  Time spent = 0.000308275 secs
mass		* 1.0

velocity	all create 1.44 87287 loop geom

region		slice block 4 6 INF INF INF INF
set		region slice type 2
  40 settings made for type

pair_style	lj/cut 2.5
pair_coeff	* * 1.0 1.0 1.0

neighbor	0.3 bin
neigh_modify	delay 0 every 1

fix		1 all nvt/sllod temp 1.0 1.0 1.0 tchain 1
fix		2 all deform 1 xy erate 0.01 remap v

#dump		1 all custom 5000 dump.nemd id type x y z

#dump		2 all image 1000 image.*.jpg type type adiam 1.2
#dump_modify	2 pad 5

#dump		3 all movie 1000 movie.mpg type type adiam 1.2
#dump_modify	3 pad 5

thermo		1000

run		50000
Neighbor list info ...
  update every 1 steps, delay 0 steps, check yes
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 1.3
  ghost atom cutoff = 1.3
  binsize = 0.65, bins = 24 19 3
  1 neighbor lists, perpetual/occasional/extra = 1 0 0
  (1) pair lj/cut, perpetual
      attributes: half, newton on
      pair build: half/bin/newton/tri
      stencil: half/bin/2d/newton/tri
      bin: standard
Per MPI rank memory allocation (min/avg/max) = 3.062 | 3.062 | 3.062 Mbytes
Step Temp E_pair E_mol TotEng Press Volume 
       0         1.44            0            0        1.431    1.2080502    189.52855 
    1000    1.1682693   0.24486562            0    1.4058332    5.8092954    189.52855 
    2000    1.0928734   0.27609364            0    1.3621366    6.2237017    189.52855 
    3000      1.09088   0.24816112            0    1.3322231    5.7001547    189.52855 
    4000    1.0110684   0.29868377            0     1.303433    7.3312319    189.52855 
    5000   0.91033678   0.28330698            0    1.1879542    6.1840352    189.52855 
    6000   0.93416074   0.22661127            0    1.1549335    5.3619735    189.52855 
    7000   0.93305734   0.19203739            0    1.1192631    5.2497547    189.52855 
    8000   0.88944438   0.19421381            0    1.0780992    4.9733446    189.52855 
    9000   0.86949257   0.21207681            0    1.0761351    5.4687076    189.52855 
   10000   0.80088203   0.24071142            0    1.0365879     5.334545    189.52855 
   11000   0.88899727   0.19972767            0    1.0831687    4.8832207    189.52855 
   12000   0.93045817   0.17883252            0    1.1034753    4.9081709    189.52855 
   13000    0.9724196   0.19089684            0    1.1572388    5.3460903    189.52855 
   14000   0.93902186   0.25513773            0    1.1882907    6.3338337    189.52855 
   15000   0.91879903   0.31605547            0     1.229112    6.2085671    189.52855 
   16000    0.9860058   0.26863362            0    1.2484769     6.514688    189.52855 
   17000    1.0354756   0.23445357            0    1.2634574    6.1519296    189.52855 
   18000    1.0244774   0.27511827            0    1.2931927    6.2230002    189.52855 
   19000    1.1581216   0.21558936            0    1.3664727    5.5458237    189.52855 
   20000    1.0552168   0.29344488            0    1.3420666    6.4880315    189.52855 
   21000   0.97925435   0.31583414            0    1.2889681    6.7584093    189.52855 
   22000    1.0112494   0.26246834            0    1.2673974    5.4112008    189.52855 
   23000    1.0463332   0.26049752            0    1.3002911    6.1359606    189.52855 
   24000    1.1130319   0.19848564            0    1.3045611    5.7088487    189.52855 
   25000    1.0355662   0.28048951            0    1.3095834    6.4596476    189.52855 
   26000    1.0823932   0.21784218            0    1.2934704     5.106334    189.52855 
   27000   0.99719525   0.32679678            0    1.3177596    6.7399277    189.52855 
   28000    1.0665868   0.25002709            0    1.3099477    6.2732557    189.52855 
   29000    1.0312798   0.30650087            0    1.3313351    7.0581024    189.52855 
   30000    1.0388277   0.29812912            0    1.3304641    6.2533028    189.52855 
   31000    1.0461658   0.21344416            0    1.2530714    5.3631154    189.52855 
   32000    1.0233681   0.27545017            0    1.2924222    5.9612896    189.52855 
   33000    1.1353086   0.20278244            0    1.3309953    5.7619128    189.52855 
   34000    1.0374791   0.29661216            0     1.327607    6.5124409    189.52855 
   35000    1.0752783   0.21684443            0    1.2854022    5.4759171    189.52855 
   36000    1.0383445   0.27068641            0    1.3025412    6.8367218    189.52855 
   37000   0.97341144   0.24034988            0    1.2076775    6.1335996    189.52855 
   38000    0.9285918    0.2737544            0    1.1965425    5.8750327    189.52855 
   39000   0.84869423   0.30079207            0     1.144182    6.8909326    189.52855 
   40000   0.88237131   0.26049171            0    1.1373482    6.3932981    189.52855 
   41000   0.90368591   0.21064132            0    1.1086792    5.5627232    189.52855 
   42000   0.93436749   0.20367569            0    1.1322034    5.1420052    189.52855 
   43000   0.91378588   0.26155533            0      1.16963     6.366756    189.52855 
   44000   0.91673608   0.25967314            0    1.1706796    6.0846334    189.52855 
   45000    1.0233334   0.25463562            0    1.2715732    6.0924255    189.52855 
   46000   0.96184729   0.35422095            0    1.3100567    7.0249175    189.52855 
   47000     1.134079   0.26196034            0    1.3889514    6.3476756    189.52855 
   48000    1.0552136     0.303812            0    1.3524305    6.6968927    189.52855 
   49000    1.1282184    0.2100955            0    1.3312626    5.8658659    189.52855 
   50000    1.0493816   0.31540438            0    1.3582274    6.6348173    189.52855 
Loop time of 1.09903 on 4 procs for 50000 steps with 160 atoms

Performance: 19653623.953 tau/day, 45494.500 timesteps/s
94.4% CPU use with 4 MPI tasks x 1 OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.057854   | 0.05974    | 0.062726   |   0.7 |  5.44
Neigh   | 0.047791   | 0.049863   | 0.054819   |   1.3 |  4.54
Comm    | 0.3581     | 0.38553    | 0.39784    |   2.6 | 35.08
Output  | 0.001116   | 0.0014414  | 0.0023859  |   1.4 |  0.13
Modify  | 0.41102    | 0.42642    | 0.4493     |   2.3 | 38.80
Other   |            | 0.176      |            |       | 16.02

Nlocal:    40 ave 42 max 39 min
Histogram: 2 0 0 1 0 0 0 0 0 1
Nghost:    36.5 ave 37 max 36 min
Histogram: 2 0 0 0 0 0 0 0 0 2
Neighs:    87.5 ave 94 max 81 min
Histogram: 1 1 0 0 0 0 0 0 1 1

Total # of neighbors = 350
Ave neighs/atom = 2.1875
Neighbor list builds = 5276
Dangerous builds = 0
Total wall time: 0:00:01
